In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2009 | 21 | Yes |
Popular Name: (1S)-1-[5-(3-fluorophenyl)-1H-imidazol-2-yl]-2-phenyl-ethanamine (1S)-1-[5-(3-fluorophenyl)-1H-im…
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 1.14 | 7.56 | -37.8 | 4 | 3 | 1 | 56 | 282.342 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.14 | 7.16 | -7.71 | 3 | 3 | 0 | 55 | 281.334 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.14 | 7.47 | -54.15 | 4 | 3 | 1 | 56 | 282.342 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.14 | 7.81 | -128.12 | 5 | 3 | 2 | 58 | 283.35 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.